Structure Info
- Chemspace ID
- CSMB00016619095 (Enamine MADE)
- MFCD
- MFCD31906556
- IUPAC Name
- 1-cyanoethyl 3-amino-6-chloropyridine-2-carboxylate
- Mol formula
- C9H8ClN3O2
- Mol weight
- 226 Da
- Catalog Number(s)
- BBV-48222044, CSC016619095, CSCR00002754403, Z1476742248, s_1458_7555678_483820, s_1458____7555678____483820
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.69
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 89
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00016619095
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